K784-1883 Screening compound: 2-ethyl-6-methyl-2H-1,4-benzoxazine-3(4H)-thione

K784-1883 Screening compound: 2-ethyl-6-methyl-2H-1,4-benzoxazine-3(4H)-thione
K784-1883 Screening compound: 2-ethyl-6-methyl-2H-1,4-benzoxazine-3(4H)-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-1883
2-ethyl-6-methyl-2H-1,4-benzoxazine-3(4H)-thione

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

K784-1883

Molecular Formula

C11H13NOS (C11 H13 NOS)

Compound Name

2-ethyl-6-methyl-2H-1,4-benzoxazine-3(4H)-thione

IUPAC name

2-ethyl-6-methyl-34-dihydro-2H-14-benzoxazine-3-thione

SMILES

CCC1Oc(ccc(C)c2)c2NC1=S

InChI

InChI=1S/C11H13NOS/c1-3-9-11(14)12-8-6-7(2)4-5-10(8)13-9/h4-6,9H,3H2,1-2H3,(H,12,14)/t9-/m0/s1

InChI Key

BXXIAULRZRJUAC-VIFPVBQESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

207.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.176

Distribution Coefficient, logD

3.175

Water Solubility, LogSw

-3.14

Polar Surface Area

19.959

Acid Dissociation Constant (pKa)

10.00

Base Dissociation Constant (pKb)

-1.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.36

K784-1883 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K784-1883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-1883?
Check Price and Availability of K784-1883, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K784-1883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-1883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-1883
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of K784-1883 available by request